VU0489531-1
TL;DR: VU0489531-1 (CAS 712309-63-2) is a chemical compound with molecular formula C24H22ClN3O2 and molecular weight 419.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-(4-chlorophenyl)-3-[4-(dimethylamino)phenyl]-3,4-dihydropyrazol-2-yl]benzoic acid
Also Known As: VU0489531-1, F1775-0029, 4-(3-(4-chlorophenyl)-5-(4-(dimethylamino)phenyl)-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid, 4-[3-(4-chlorophenyl)-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid, 4-[3-(4-chlorophenyl)-5-(4-dimethylaminophenyl)-4,5-dihydropyrazol-1-yl]benzoic Acid
| Molecular Formula | C24H22ClN3O2 |
|---|---|
| Molecular Weight | 419.14 g/mol |
| LogP | 5.4599 |
| Topological Polar Surface Area | 56.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.14005 |
| Heavy Atoms | 30 |
| Complexity | 1074.9437 |
Chemical Identifiers
| CAS Number | 712309-63-2 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)Cl |
Product Overview
VU0489531-1 (CAS 712309-63-2), with molecular formula C24H22ClN3O2 and molecular weight 419.14 g/mol. IUPAC: 4-[5-(4-chlorophenyl)-3-[4-(dimethylamino)phenyl]-3,4-dihydropyrazol-2-yl]benzoic acid.
Chemical Property Profile of VU0489531-1
Property Insights of VU0489531-1
The XLogP value of 5.4599 indicates that VU0489531-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.14 Ų, VU0489531-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0489531-1 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of VU0489531-1?
The CAS number of VU0489531-1 is 712309-63-2.
What is the molecular formula of VU0489531-1?
The molecular formula of VU0489531-1 is C24H22ClN3O2.
What is the molecular weight of VU0489531-1?
The molecular weight of VU0489531-1 is 419.14 g/mol.
Where can I buy VU0489531-1?
You can request a quote for VU0489531-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0489531-1?
Yes, KEHONG BIO provides custom synthesis services for VU0489531-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.